HCID2776178

(2,3-Dihydro-1,4-benzodioxin-6-yl)boronic acid

2,3-dihydro-1,4-benzodioxin-6-ylboronic acid

C8H9BO4179.97 g/molCAS 164014-95-3

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IDENTITY

结构与身份

标准SMILES: OB(O)c1ccc2c(c1)OCCO2
InChIKey: SQDUGGGBJXULJR-UHFFFAOYSA-N
分子式: C8H9BO4
平均分子量: 179.97 g/mol
单同位素质量: 180.0593889

COMPUTED

结构计算性质

等待补全

极性表面积: 58.9 Å²
氢键供体: 2
氢键受体: 4
可旋转键: 1
重原子: 13
形式电荷: 0
复杂度: 176

物化、安全与法规信息正在同步。

ALIASES

名称与别名

共 42 条

(2,3-dihydro-1,4-benzodioxin-6-yl)boronic acidRefChem:394491625-755-91,4-Benzodioxane-6-boronic acid164014-95-32,3-dihydro-1,4-benzodioxin-6-ylboronic acid(2,3-dihydrobenzo[b][1,4]dioxin-6-yl)boronic acidMFCD01009696Boronic acid, B-(2,3-dihydro-1,4-benzodioxin-6-yl)-BORONIC ACID, (2,3-DIHYDRO-1,4-BENZODIOXIN-6-YL)-1,4-Benzodioxan-6-boronic acid3,4-(ethylenedioxy)benzeneboronic acid1,4-Benzodioxane-6-boronicacid2,3-dihydro-1,4-(benzodioxin-6-yl)boronic acidSCHEMBL121851orb2940004DTXSID00379869SQDUGGGBJXULJR-UHFFFAOYSA-N3,4-ethylenedioxyphenylboronic acidALBB-012243

REACTIONS

参与反应

54 条

uspto-grants-2014_09 · 10.6084/m9.figshare.5104873.v1 · US08846661B2

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uspto-grants-2014_09 · 10.6084/m9.figshare.5104873.v1 · US08846677B2

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Training data from https://doi.org/10.1039/C8SC04228D (2/10) · 10.1039/C8SC04228D

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Training data from https://doi.org/10.1039/C8SC04228D (2/10) · 10.1039/C8SC04228D

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Training data from https://doi.org/10.1039/C8SC04228D (9/10) · 10.1039/C8SC04228D

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uspto-grants-2014_02 · 10.6084/m9.figshare.5104873.v1 · US08642604B2

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uspto-grants-2014_02 · 10.6084/m9.figshare.5104873.v1 · US08642604B2

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uspto-grants-2014_02 · 10.6084/m9.figshare.5104873.v1 · US08642788B2

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